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{
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{
"id": "mp-1181303",
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{
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{
"id": "mp-1194253",
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"structure_string": "Hf18 W8 Se2\n1.0\n4.373547 -7.575206 0.000000\n4.373547 7.575206 0.000000\n0.000000 0.000000 8.656216\nHf W Se\n18 8 2\ndirect\n0.193296 0.806704 0.452262 Hf\n0.193296 0.386591 0.452262 Hf\n0.613409 0.806704 0.452262 Hf\n0.806704 0.193296 0.547738 Hf\n0.806704 0.613409 0.547738 Hf\n0.386591 0.193296 0.547738 Hf\n0.806704 0.193296 0.952262 Hf\n0.806704 0.613409 0.952262 Hf\n0.386591 0.193296 0.952262 Hf\n0.193296 0.806704 0.047738 Hf\n0.193296 0.386591 0.047738 Hf\n0.613409 0.806704 0.047738 Hf\n0.542566 0.457434 0.250000 Hf\n0.542566 0.085133 0.250000 Hf\n0.914867 0.457434 0.250000 Hf\n0.457434 0.542566 0.750000 Hf\n0.457434 0.914867 0.750000 Hf\n0.085133 0.542566 0.750000 Hf\n0.889917 0.110083 0.250000 W\n0.889917 0.779834 0.250000 W\n0.220166 0.110083 0.250000 W\n0.110083 0.889917 0.750000 W\n0.110083 0.220166 0.750000 W\n0.779834 0.889917 0.750000 W\n0.000000 0.000000 0.500000 W\n0.000000 0.000000 0.000000 W\n0.333333 0.666667 0.250000 Se\n0.666667 0.333333 0.750000 Se\n",
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"formula_full": "Hf18 W8 Se2",
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{
"id": "mp-1245361",
"created_at": "2022-09-04T14:43:52.183146Z",
"structure_string": "Li56 Ir8 N32\n1.0\n9.786406 0.000000 0.000000\n0.000000 9.786406 0.000000\n0.000000 0.000000 9.786406\nLi Ir N\n56 8 32\ndirect\n0.366328 0.633672 0.133672 Li\n0.633672 0.133672 0.366328 Li\n0.133672 0.366328 0.633672 Li\n0.866328 0.866328 0.866328 Li\n0.633672 0.366328 0.866328 Li\n0.366328 0.866328 0.633672 Li\n0.866328 0.633672 0.366328 Li\n0.133672 0.133672 0.133672 Li\n0.367529 0.631154 0.384207 Li\n0.632471 0.131154 0.115793 Li\n0.132471 0.368846 0.884207 Li\n0.867529 0.868846 0.615793 Li\n0.384207 0.367529 0.631154 Li\n0.115793 0.632471 0.131154 Li\n0.884207 0.132471 0.368846 Li\n0.615793 0.867529 0.868846 Li\n0.631154 0.384207 0.367529 Li\n0.131154 0.115793 0.632471 Li\n0.368846 0.884207 0.132471 Li\n0.868846 0.615793 0.867529 Li\n0.632471 0.368846 0.615793 Li\n0.367529 0.868846 0.884207 Li\n0.867529 0.631154 0.115793 Li\n0.132471 0.131154 0.384207 Li\n0.615793 0.632471 0.368846 Li\n0.884207 0.367529 0.868846 Li\n0.115793 0.867529 0.631154 Li\n0.384207 0.132471 0.131154 Li\n0.368846 0.615793 0.632471 Li\n0.868846 0.884207 0.367529 Li\n0.631154 0.115793 0.867529 Li\n0.131154 0.384207 0.132471 Li\n0.393401 0.866330 0.382353 Li\n0.606599 0.366330 0.117647 Li\n0.106599 0.133670 0.882353 Li\n0.893401 0.633670 0.617647 Li\n0.382353 0.393401 0.866330 Li\n0.117647 0.606599 0.366330 Li\n0.882353 0.106599 0.133670 Li\n0.617647 0.893401 0.633670 Li\n0.866330 0.382353 0.393401 Li\n0.366330 0.117647 0.606599 Li\n0.133670 0.882353 0.106599 Li\n0.633670 0.617647 0.893401 Li\n0.606599 0.133670 0.617647 Li\n0.393401 0.633670 0.882353 Li\n0.893401 0.866330 0.117647 Li\n0.106599 0.366330 0.382353 Li\n0.617647 0.606599 0.133670 Li\n0.882353 0.393401 0.633670 Li\n0.117647 0.893401 0.866330 Li\n0.382353 0.106599 0.366330 Li\n0.133670 0.617647 0.606599 Li\n0.633670 0.882353 0.393401 Li\n0.866330 0.117647 0.893401 Li\n0.366330 0.382353 0.106599 Li\n0.127037 0.872963 0.372963 Ir\n0.872963 0.372963 0.127037 Ir\n0.372963 0.127037 0.872963 Ir\n0.627037 0.627037 0.627037 Ir\n0.872963 0.127037 0.627037 Ir\n0.127037 0.627037 0.872963 Ir\n0.627037 0.872963 0.127037 Ir\n0.372963 0.372963 0.372963 Ir\n0.243739 0.756261 0.256261 N\n0.756261 0.256261 0.243739 N\n0.256261 0.243739 0.756261 N\n0.743739 0.743739 0.743739 N\n0.756261 0.243739 0.743739 N\n0.243739 0.743739 0.756261 N\n0.743739 0.756261 0.243739 N\n0.256261 0.256261 0.256261 N\n0.015577 0.993097 0.253816 N\n0.984423 0.493097 0.246184 N\n0.484423 0.006903 0.753816 N\n0.515577 0.506903 0.746184 N\n0.253816 0.015577 0.993097 N\n0.246184 0.984423 0.493097 N\n0.753816 0.484423 0.006903 N\n0.746184 0.515577 0.506903 N\n0.993097 0.253816 0.015577 N\n0.493097 0.246184 0.984423 N\n0.006903 0.753816 0.484423 N\n0.506903 0.746184 0.515577 N\n0.984423 0.006903 0.746184 N\n0.015577 0.506903 0.753816 N\n0.515577 0.993097 0.246184 N\n0.484423 0.493097 0.253816 N\n0.746184 0.984423 0.006903 N\n0.753816 0.015577 0.506903 N\n0.246184 0.515577 0.993097 N\n0.253816 0.484423 0.493097 N\n0.006903 0.746184 0.984423 N\n0.506903 0.753816 0.015577 N\n0.993097 0.246184 0.515577 N\n0.493097 0.253816 0.484423 N\n",
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"formula_full": "Li56 Ir8 N32",
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{
"id": "mp-771078",
"created_at": "2022-09-04T14:43:52.189535Z",
"structure_string": "Li12 Fe4 B4 O20\n1.0\n4.788951 0.000000 0.000000\n0.000000 4.811281 0.000000\n0.000000 0.000000 16.335093\nLi Fe B O\n12 4 4 20\ndirect\n0.313770 0.991928 0.611552 Li\n0.813770 0.991928 0.888448 Li\n0.683730 0.496644 0.007902 Li\n0.183730 0.496644 0.492098 Li\n0.669894 0.504761 0.793128 Li\n0.169894 0.504761 0.706872 Li\n0.686230 0.491928 0.388448 Li\n0.186230 0.491928 0.111552 Li\n0.316270 0.996644 0.992098 Li\n0.816270 0.996644 0.507902 Li\n0.830106 0.004761 0.293128 Li\n0.330106 0.004761 0.206872 Li\n0.818567 0.989843 0.104637 Fe\n0.318567 0.989843 0.395363 Fe\n0.681433 0.489843 0.604637 Fe\n0.181433 0.489843 0.895363 Fe\n0.819613 0.003995 0.707381 B\n0.319613 0.003995 0.792619 B\n0.680387 0.503995 0.207381 B\n0.180387 0.503995 0.292619 B\n0.619950 0.910871 0.774587 O\n0.119950 0.910871 0.725413 O\n0.675152 0.905562 0.397743 O\n0.175152 0.905562 0.102257 O\n0.716752 0.911761 0.003439 O\n0.216752 0.911761 0.496561 O\n0.682615 0.811168 0.199479 O\n0.182615 0.811168 0.300521 O\n0.737564 0.878466 0.627454 O\n0.237564 0.878466 0.872546 O\n0.380050 0.410871 0.225413 O\n0.880050 0.410871 0.274587 O\n0.824848 0.405562 0.897743 O\n0.324848 0.405562 0.602257 O\n0.783248 0.411761 0.503439 O\n0.283248 0.411761 0.996561 O\n0.817385 0.311168 0.699479 O\n0.317385 0.311168 0.800521 O\n0.762436 0.378466 0.127454 O\n0.262436 0.378466 0.372546 O\n",
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{
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{
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"structure_string": "Tb3 Ni9 Sn6\n1.0\n0.000000 0.000000 -4.239561\n-9.285519 -0.005003 0.000000\n-4.638427 8.043997 0.000000\nTb Ni Sn\n3 9 6\ndirect\n0.500000 0.333297 0.333413 Tb\n0.500000 0.666587 0.666703 Tb\n0.000000 0.000323 0.999677 Tb\n0.000000 0.203888 0.168633 Ni\n0.000000 0.168449 0.627029 Ni\n0.000000 0.627371 0.204406 Ni\n0.000000 0.831367 0.796112 Ni\n0.000000 0.372971 0.831551 Ni\n0.000000 0.795594 0.372629 Ni\n0.500000 0.298045 0.701955 Ni\n0.500000 0.701941 0.999878 Ni\n0.500000 0.000122 0.298059 Ni\n0.500000 0.747187 0.252813 Sn\n0.500000 0.253044 0.999956 Sn\n0.500000 0.000044 0.746956 Sn\n0.000000 0.472923 0.527077 Sn\n0.000000 0.526916 0.000170 Sn\n0.000000 0.999830 0.473084 Sn\n",
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{
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